#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k70 s SER 2 N 0.00 7.13 0.46 1.61 0.01 -1.26 -4.93 113.70 116.72 2k70 s SER 2 Ca 0.00 1.39 0.30 0.00 1.31 0.00 0.00 55.95 58.95 2k70 s SER 2 Cb 0.00 -2.52 1.13 0.00 0.21 0.00 0.00 66.02 64.84 2k70 s SER 2 CO 0.00 -0.43 1.87 -0.26 0.41 0.00 0.00 173.24 174.83 2k70 h PHE 3 N 7.17 0.00 -1.07 2.43 0.04 -1.98 -3.47 116.94 120.06 2k70 h PHE 3 Ca -0.30 0.00 -0.36 0.00 2.80 0.00 0.00 57.97 60.11 2k70 h PHE 3 Cb 1.14 0.00 -0.14 0.00 2.20 0.00 0.00 35.95 39.15 2k70 h PHE 3 CO 0.71 0.00 -0.33 0.25 -0.60 0.00 0.00 178.31 178.35 2k70 n THR 4 N -2.87 0.00 -2.46 -1.55 -2.24 -1.26 -4.92 114.28 98.98 2k70 n THR 4 Ca 0.02 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.41 2k70 n THR 4 Cb 0.32 -1.71 -0.03 0.00 -2.10 0.00 0.00 70.33 66.81 2k70 n THR 4 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2k70 s GLU 5 N -3.47 3.38 0.27 -0.78 2.02 -1.26 -4.85 118.70 114.01 2k70 s GLU 5 Ca 0.00 -0.95 -0.19 0.00 0.02 0.00 0.00 54.97 53.85 2k70 s GLU 5 Cb 0.00 -5.29 0.01 0.00 0.10 0.00 0.00 34.13 28.96 2k70 s GLU 5 CO 0.00 -2.44 0.66 0.20 0.02 0.00 0.00 175.26 173.71 2k70 s GLY 6 N 5.56 0.07 -0.22 -1.39 0.00 -1.26 -0.67 107.32 109.41 2k70 s GLY 6 Ca 0.51 -0.45 -0.25 0.00 0.00 0.00 0.00 44.72 44.52 2k70 s GLY 6 CO -0.08 -0.22 0.68 0.66 0.00 0.00 0.00 173.10 174.14 2k70 s TRP 7 N -3.92 -0.73 0.28 1.90 -2.14 -0.34 -4.08 118.94 109.91 2k70 s TRP 7 Ca 0.14 1.71 -0.28 0.00 2.66 0.00 0.00 56.10 60.33 2k70 s TRP 7 Cb -0.05 0.28 -0.09 0.00 -3.10 0.00 0.00 33.47 30.51 2k70 s TRP 7 CO 0.08 -0.40 0.94 0.08 -2.66 0.00 0.00 176.95 174.99 2k70 s VAL 8 N 0.12 4.15 -1.28 -0.66 1.01 -0.21 -1.24 120.40 122.28 2k70 s VAL 8 Ca -0.02 1.94 0.08 0.00 0.00 0.00 0.00 61.98 63.99 2k70 s VAL 8 Cb -0.04 -4.16 0.34 0.00 0.00 0.00 0.00 36.38 32.52 2k70 s VAL 8 CO 0.02 0.32 1.16 -1.14 0.00 0.00 0.00 175.10 175.46 2k70 n ARG 9 N 1.02 2.33 -1.12 2.72 0.00 0.19 -0.29 116.66 121.50 2k70 n ARG 9 Ca -0.00 -1.34 0.14 0.00 -0.00 0.00 0.00 57.85 56.64 2k70 n ARG 9 Cb 0.49 -1.58 -0.07 0.00 0.00 0.00 0.00 32.46 31.30 2k70 n ARG 9 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 2k70 n PHE 10 N 0.38 -2.96 -3.59 -0.14 7.35 -0.80 -4.10 117.46 113.60 2k70 n PHE 10 Ca 0.12 1.61 -0.07 0.00 -0.76 0.00 0.00 57.45 58.35 2k70 n PHE 10 Cb 0.50 -2.70 -0.04 0.00 0.35 0.00 0.00 39.48 37.60 2k70 n PHE 10 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 2k70 s SER 11 N -6.61 -0.23 -0.17 -2.13 0.01 -1.26 -4.63 113.70 98.68 2k70 s SER 11 Ca 0.00 0.16 0.01 0.00 1.31 0.00 0.00 55.95 57.43 2k70 s SER 11 Cb 0.00 0.21 0.24 0.00 0.21 0.00 0.00 66.02 66.68 2k70 s SER 11 CO 0.00 -0.28 1.38 -0.81 0.41 0.00 0.00 173.24 173.94 2k70 n PRO 12 N 0.33 1.47 -3.92 12.44 -0.04 -1.26 -4.62 135.00 139.40 2k70 n PRO 12 Ca -0.05 -1.12 -0.11 0.00 -0.04 0.00 0.00 63.50 62.18 2k70 n PRO 12 Cb 0.59 -1.44 -0.00 0.00 -0.04 0.00 0.00 33.50 32.61 2k70 n PRO 12 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k70 s GLY 13 N 0.17 0.84 0.51 0.55 0.00 -1.26 -5.07 107.32 103.06 2k70 s GLY 13 Ca 0.21 -1.07 0.30 0.00 0.00 0.00 0.00 44.72 44.16 2k70 s GLY 13 CO 0.04 -0.59 1.93 -0.56 0.00 0.00 0.00 173.10 173.92 2k70 h PRO 14 N 2.04 0.00 -6.56 2.90 0.13 -1.94 -3.43 132.00 125.13 2k70 h PRO 14 Ca -0.31 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.30 2k70 h PRO 14 Cb 1.25 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.35 2k70 h PRO 14 CO 0.40 0.09 0.00 -0.80 -0.23 0.00 0.00 178.00 177.46 2k70 s ASN 15 N -5.91 6.76 0.32 1.44 -0.87 -1.26 -0.84 114.94 114.58 2k70 s ASN 15 Ca 0.01 1.15 -0.02 0.00 -1.57 0.00 0.00 52.86 52.42 2k70 s ASN 15 Cb 0.10 -2.32 0.01 0.00 -0.02 0.00 0.00 41.25 39.02 2k70 s ASN 15 CO 0.58 -0.09 0.46 0.00 -2.57 0.00 0.00 177.10 175.48 2k70 n ALA 16 N -0.02 -0.40 -3.00 0.60 0.00 -0.02 -4.59 120.51 113.09 2k70 n ALA 16 Ca 0.01 -1.44 -0.10 0.00 0.00 0.00 0.00 53.44 51.91 2k70 n ALA 16 Cb 0.52 1.16 -0.10 0.00 0.00 0.00 0.00 19.45 21.03 2k70 n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k70 s ALA 17 N -2.61 -0.10 -0.05 0.00 0.00 -1.26 -0.85 121.76 116.89 2k70 s ALA 17 Ca 0.25 -0.39 -0.08 0.00 0.00 0.00 0.00 51.96 51.75 2k70 s ALA 17 Cb -0.01 0.14 0.02 0.00 0.00 0.00 0.00 23.12 23.27 2k70 s ALA 17 CO 0.18 -0.20 0.19 0.00 0.00 0.00 0.00 175.76 175.93 2k70 s ALA 18 N -1.58 -0.47 0.20 0.00 0.00 0.19 -0.64 121.76 119.46 2k70 s ALA 18 Ca -0.14 0.37 0.08 0.00 0.00 0.00 0.00 51.96 52.27 2k70 s ALA 18 Cb -0.08 -0.19 -0.04 0.00 0.00 0.00 0.00 23.12 22.81 2k70 s ALA 18 CO -0.00 -0.14 0.00 0.71 0.00 0.00 0.00 175.76 176.34 2k70 s TYR 19 N -0.38 2.81 -0.08 0.00 2.02 -0.37 -1.63 117.35 119.73 2k70 s TYR 19 Ca -0.05 -0.16 -0.31 0.00 -0.37 0.00 0.00 57.07 56.19 2k70 s TYR 19 Cb -0.03 -1.33 0.12 0.00 -0.40 0.00 0.00 41.96 40.31 2k70 s TYR 19 CO 0.01 0.54 0.99 -0.48 -1.57 0.00 0.00 175.55 175.04 2k70 s LEU 20 N -3.16 -0.30 -0.48 -1.29 0.05 -1.23 -1.19 118.68 111.07 2k70 s LEU 20 Ca 0.29 0.06 -0.20 0.00 0.05 0.00 0.00 54.13 54.33 2k70 s LEU 20 Cb -0.08 1.83 0.04 0.00 -2.05 0.00 0.00 46.19 45.92 2k70 s LEU 20 CO 0.19 -0.47 0.63 0.42 -0.55 0.00 0.00 176.35 176.57 2k70 s THR 21 N -2.61 4.85 0.22 5.48 -4.23 0.16 -0.92 115.64 118.58 2k70 s THR 21 Ca 0.05 -0.23 -0.30 0.00 -1.18 0.00 0.00 61.69 60.03 2k70 s THR 21 Cb -0.01 -4.26 -0.08 0.00 1.34 0.00 0.00 72.50 69.49 2k70 s THR 21 CO -0.06 -0.72 0.96 -0.22 -0.54 0.00 0.00 174.62 174.04 2k70 s LEU 22 N 2.73 4.61 0.28 4.79 1.98 0.36 -4.71 118.68 128.73 2k70 s LEU 22 Ca 0.18 1.95 0.10 0.00 -2.89 0.00 0.00 54.13 53.47 2k70 s LEU 22 Cb -0.17 -3.61 -0.05 0.00 0.66 0.00 0.00 46.19 43.03 2k70 s LEU 22 CO 0.15 0.09 -0.04 -1.83 -1.89 0.00 0.00 176.35 172.83 2k70 s GLU 23 N -0.99 2.16 -0.19 1.98 -1.05 -1.26 -0.48 118.70 118.87 2k70 s GLU 23 Ca 0.42 -1.52 -0.03 0.00 -0.15 0.00 0.00 54.97 53.69 2k70 s GLU 23 Cb -0.26 -2.06 0.06 0.00 -0.44 0.00 0.00 34.13 31.43 2k70 s GLU 23 CO 0.32 0.33 0.05 1.21 0.95 0.00 0.00 175.26 178.12 2k70 s ASN 24 N -3.65 2.79 0.00 0.83 3.84 0.05 -4.94 114.94 113.85 2k70 s ASN 24 Ca 0.32 -0.78 0.26 0.00 0.21 0.00 0.00 52.86 52.87 2k70 s ASN 24 Cb -0.05 -0.51 0.72 0.00 -0.55 0.00 0.00 41.25 40.85 2k70 s ASN 24 CO 0.19 -0.32 1.56 -0.81 -2.79 0.00 0.00 177.10 174.93 2k70 n PRO 25 N 5.10 0.24 -2.87 0.43 -0.04 -1.26 -1.62 135.00 134.98 2k70 n PRO 25 Ca -0.08 -0.12 -0.21 0.00 -0.04 0.00 0.00 63.50 63.04 2k70 n PRO 25 Cb 0.48 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.52 2k70 n PRO 25 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k70 s GLY 26 N -2.84 1.75 0.00 0.55 0.00 -1.26 -4.69 107.32 100.82 2k70 s GLY 26 Ca 0.16 -1.98 0.26 0.00 0.00 0.00 0.00 44.72 43.16 2k70 s GLY 26 CO 0.62 -1.49 1.57 1.22 0.00 0.00 0.00 173.10 175.03 2k70 n ASP 27 N -2.46 2.03 -4.61 1.64 8.00 -1.26 -1.43 116.55 118.46 2k70 n ASP 27 Ca 0.15 -1.68 -0.25 0.00 0.71 0.00 0.00 54.79 53.72 2k70 n ASP 27 Cb 0.61 -0.02 -0.08 0.00 -0.02 0.00 0.00 41.12 41.61 2k70 n ASP 27 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 2k70 s LEU 28 N -1.94 3.10 0.37 0.64 0.05 -1.26 -4.81 118.68 114.83 2k70 s LEU 28 Ca 0.35 -0.59 -0.25 0.00 0.05 0.00 0.00 54.13 53.69 2k70 s LEU 28 Cb 0.20 -1.71 -0.09 0.00 -2.05 0.00 0.00 46.19 42.54 2k70 s LEU 28 CO 0.32 0.06 1.01 -2.16 -0.55 0.00 0.00 176.35 175.02 2k70 s PRO 29 N -3.22 4.34 0.22 1.48 0.04 -1.26 -4.10 135.00 132.49 2k70 s PRO 29 Ca 0.28 1.42 0.07 0.00 0.04 0.00 0.00 61.00 62.81 2k70 s PRO 29 Cb -0.08 -2.62 -0.04 0.00 0.04 0.00 0.00 34.50 31.80 2k70 s PRO 29 CO 0.18 0.03 0.13 -0.51 0.04 0.00 0.00 177.00 176.86 2k70 s LEU 30 N -2.44 3.67 -0.21 -3.56 2.01 -0.40 -4.99 118.68 112.76 2k70 s LEU 30 Ca 0.55 -0.28 -0.04 0.00 0.01 0.00 0.00 54.13 54.37 2k70 s LEU 30 Cb -0.20 -2.24 0.11 0.00 0.01 0.00 0.00 46.19 43.87 2k70 s LEU 30 CO 0.25 0.02 0.27 -0.60 1.01 0.00 0.00 176.35 177.30 2k70 s ARG 31 N -3.47 0.24 -0.40 1.70 3.52 -1.26 -0.28 118.95 119.01 2k70 s ARG 31 Ca 0.31 0.33 -0.21 0.00 -0.13 0.00 0.00 55.73 56.03 2k70 s ARG 31 Cb -0.09 -0.93 0.01 0.00 -1.56 0.00 0.00 34.95 32.38 2k70 s ARG 31 CO 0.23 -0.64 0.68 -1.17 -0.81 0.00 0.00 175.30 173.59 2k70 s LEU 32 N 2.40 4.31 -0.02 -0.88 2.96 0.50 -0.93 118.68 127.02 2k70 s LEU 32 Ca 0.09 -0.01 0.12 0.00 -0.22 0.00 0.00 54.13 54.11 2k70 s LEU 32 Cb -0.16 -2.83 -0.19 0.00 0.50 0.00 0.00 46.19 43.51 2k70 s LEU 32 CO -0.13 -0.72 0.26 1.33 -1.32 0.00 0.00 176.35 175.77 2k70 n VAL 33 N 5.79 0.03 -3.47 1.68 0.24 0.22 -0.68 118.33 122.14 2k70 n VAL 33 Ca -0.00 -0.29 -0.05 0.00 -2.04 0.00 0.00 64.34 61.96 2k70 n VAL 33 Cb 0.48 0.18 0.01 0.00 -1.47 0.00 0.00 33.84 33.04 2k70 n VAL 33 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k70 n GLY 34 N 1.81 1.64 2.60 7.63 0.00 -0.79 -4.76 105.19 113.32 2k70 n GLY 34 Ca -0.03 -1.19 -0.10 0.00 0.00 0.00 0.00 46.02 44.70 2k70 n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k70 n ALA 35 N -1.76 -0.45 -3.50 4.61 0.00 -1.26 -1.08 120.51 117.07 2k70 n ALA 35 Ca -0.08 -1.18 -0.08 0.00 0.00 0.00 0.00 53.44 52.10 2k70 n ALA 35 Cb 0.30 0.95 -0.04 0.00 0.00 0.00 0.00 19.45 20.67 2k70 n ALA 35 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2k70 s ARG 36 N -2.51 1.64 -0.25 0.00 0.52 -0.11 -4.79 118.95 113.46 2k70 s ARG 36 Ca 0.20 -1.10 -0.30 0.00 -0.52 0.00 0.00 55.73 54.01 2k70 s ARG 36 Cb -0.01 0.54 0.17 0.00 0.52 0.00 0.00 34.95 36.17 2k70 s ARG 36 CO 0.15 -0.72 1.25 -0.08 0.02 0.00 0.00 175.30 175.92 2k70 s THR 37 N -3.96 0.00 -0.25 0.02 -1.32 -1.26 -0.90 115.64 107.97 2k70 s THR 37 Ca 0.16 0.00 0.28 0.00 -1.21 0.00 0.00 61.69 60.92 2k70 s THR 37 Cb -0.03 -1.00 0.33 0.00 -1.51 0.00 0.00 72.50 70.29 2k70 s THR 37 CO 0.07 0.00 1.83 1.55 -2.21 0.00 0.00 174.62 175.86 2k70 h PRO 38 N 2.18 0.00 -2.08 7.08 0.13 -2.00 -3.23 132.00 134.08 2k70 h PRO 38 Ca -0.11 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 64.31 2k70 h PRO 38 Cb 1.18 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.07 2k70 h PRO 38 CO 0.24 0.00 0.99 1.33 -0.23 0.00 0.00 178.00 180.33 2k70 n VAL 39 N -2.72 4.04 -3.84 1.56 0.24 -1.26 -4.44 118.33 111.91 2k70 n VAL 39 Ca 0.02 -4.24 -0.09 0.00 -2.04 0.00 0.00 64.34 57.99 2k70 n VAL 39 Cb 0.32 -1.43 -0.04 0.00 -1.47 0.00 0.00 33.84 31.22 2k70 n VAL 39 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k70 s ALA 40 N -3.34 -0.82 -0.23 2.33 0.00 -1.22 -3.99 121.76 114.48 2k70 s ALA 40 Ca 0.52 -0.41 0.03 0.00 0.00 0.00 0.00 51.96 52.09 2k70 s ALA 40 Cb 0.37 0.91 -0.16 0.00 0.00 0.00 0.00 23.12 24.24 2k70 s ALA 40 CO -0.30 -0.87 -0.19 -1.91 0.00 0.00 0.00 175.76 172.49 2k70 n GLU 41 N -0.38 0.62 -4.09 0.00 0.00 0.50 -4.76 120.64 112.53 2k70 n GLU 41 Ca -0.06 0.12 -0.10 0.00 0.00 0.00 0.00 57.16 57.12 2k70 n GLU 41 Cb 0.61 -1.47 -0.08 0.00 0.00 0.00 0.00 31.44 30.51 2k70 n GLU 41 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.13 176.15 2k70 s ARG 42 N -2.47 1.36 -0.03 5.31 1.70 -1.05 -5.05 118.95 118.71 2k70 s ARG 42 Ca -0.30 -1.42 -0.07 0.00 -0.47 0.00 0.00 55.73 53.47 2k70 s ARG 42 Cb 0.08 0.37 0.01 0.00 -0.57 0.00 0.00 34.95 34.84 2k70 s ARG 42 CO 0.56 -0.51 0.17 0.54 -1.08 0.00 0.00 175.30 174.98 2k70 s VAL 43 N -4.08 0.04 0.09 4.99 0.11 -1.26 -1.46 120.40 118.84 2k70 s VAL 43 Ca 0.30 -0.36 0.06 0.00 -2.93 0.00 0.00 61.98 59.05 2k70 s VAL 43 Cb 0.03 -0.36 -0.03 0.00 -1.53 0.00 0.00 36.38 34.49 2k70 s VAL 43 CO 0.10 -0.20 -0.16 -1.61 -3.33 0.00 0.00 175.10 169.90 2k70 s GLU 44 N -0.69 0.96 -0.13 1.54 2.02 -0.38 -4.88 118.70 117.15 2k70 s GLU 44 Ca -0.08 -1.09 -0.05 0.00 0.02 0.00 0.00 54.97 53.77 2k70 s GLU 44 Cb -0.05 -1.01 -0.04 0.00 0.10 0.00 0.00 34.13 33.13 2k70 s GLU 44 CO 0.01 0.22 0.07 -0.48 0.02 0.00 0.00 175.26 175.10 2k70 s LEU 45 N -1.98 3.92 0.17 1.80 2.34 -1.26 -0.32 118.68 123.34 2k70 s LEU 45 Ca 0.03 0.23 0.11 0.00 0.06 0.00 0.00 54.13 54.56 2k70 s LEU 45 Cb -0.09 -1.95 -0.04 0.00 -0.56 0.00 0.00 46.19 43.56 2k70 s LEU 45 CO 0.03 0.33 -0.24 -1.00 -1.06 0.00 0.00 176.35 174.41 2k70 s HIS 46 N -0.55 2.23 0.35 3.48 3.76 0.31 -0.62 115.29 124.26 2k70 s HIS 46 Ca 0.11 -0.38 0.04 0.00 -0.15 0.00 0.00 55.06 54.68 2k70 s HIS 46 Cb -0.12 -1.14 -0.01 0.00 1.11 0.00 0.00 32.58 32.42 2k70 s HIS 46 CO 0.02 0.43 0.52 -1.83 -0.85 0.00 0.00 174.74 173.03 2k70 s GLU 47 N -2.48 3.22 0.01 1.40 -1.05 0.08 -1.15 118.70 118.73 2k70 s GLU 47 Ca 0.18 -0.71 0.06 0.00 -0.15 0.00 0.00 54.97 54.35 2k70 s GLU 47 Cb -0.08 -2.73 -0.03 0.00 -0.44 0.00 0.00 34.13 30.84 2k70 s GLU 47 CO 0.08 0.05 -0.18 0.99 0.95 0.00 0.00 175.26 177.15 2k70 s THR 48 N -2.27 2.79 0.23 1.83 2.01 0.31 -2.40 115.64 118.14 2k70 s THR 48 Ca 0.43 -1.05 0.01 0.00 0.31 0.00 0.00 61.69 61.40 2k70 s THR 48 Cb -0.10 -2.13 -0.04 0.00 0.01 0.00 0.00 72.50 70.25 2k70 s THR 48 CO 0.33 0.44 0.16 0.72 -0.69 0.00 0.00 174.62 175.58 2k70 s PHE 49 N -0.84 1.30 0.01 4.92 -0.12 -0.07 -4.69 117.98 118.49 2k70 s PHE 49 Ca 0.13 -1.44 0.05 0.00 -0.05 0.00 0.00 56.93 55.61 2k70 s PHE 49 Cb -0.10 -0.60 -0.03 0.00 -0.63 0.00 0.00 43.02 41.65 2k70 s PHE 49 CO 0.03 -0.69 -0.12 -1.64 -0.05 0.00 0.00 175.22 172.75 2k70 s MET 50 N -3.99 2.38 -0.03 1.99 -1.94 -1.26 -1.04 119.30 115.40 2k70 s MET 50 Ca 0.39 -0.81 -0.10 0.00 -1.71 0.00 0.00 55.69 53.47 2k70 s MET 50 Cb 0.06 -2.37 0.01 0.00 2.01 0.00 0.00 34.83 34.54 2k70 s MET 50 CO 0.16 0.59 0.22 1.03 -0.01 0.00 0.00 175.02 177.00 2k70 s ARG 51 N -1.29 0.48 0.02 2.03 0.52 -0.21 -4.95 118.95 115.55 2k70 s ARG 51 Ca 0.15 -0.12 -0.12 0.00 -0.52 0.00 0.00 55.73 55.12 2k70 s ARG 51 Cb -0.11 0.21 -0.06 0.00 0.52 0.00 0.00 34.95 35.52 2k70 s ARG 51 CO 0.05 -0.11 0.39 -2.00 0.02 0.00 0.00 175.30 173.65 2k70 s GLU 52 N -0.92 3.83 -0.03 3.54 2.56 -1.26 -0.36 118.70 126.07 2k70 s GLU 52 Ca -0.10 0.29 -0.01 0.00 0.00 0.00 0.00 54.97 55.16 2k70 s GLU 52 Cb -0.05 -3.13 0.03 0.00 2.00 0.00 0.00 34.13 32.98 2k70 s GLU 52 CO 0.02 0.65 0.03 0.14 -0.56 0.00 0.00 175.26 175.54 2k70 s VAL 53 N -1.20 -0.03 -0.15 3.70 -7.23 -0.32 -4.88 120.40 110.28 2k70 s VAL 53 Ca 0.27 0.26 0.00 0.00 -1.81 0.00 0.00 61.98 60.70 2k70 s VAL 53 Cb -0.15 -0.14 0.00 0.00 0.56 0.00 0.00 36.38 36.65 2k70 s VAL 53 CO 0.15 0.13 0.00 -0.62 -0.31 0.00 0.00 175.10 174.44 2k70 n GLU 54 N 4.51 -1.49 -1.33 4.82 1.02 -1.26 -0.71 120.64 126.20 2k70 n GLU 54 Ca -0.20 0.44 0.00 0.00 -0.02 0.00 0.00 57.16 57.38 2k70 n GLU 54 Cb 0.50 -4.59 0.00 0.00 -0.02 0.00 0.00 31.44 27.33 2k70 n GLU 54 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k70 n GLY 55 N -0.03 0.62 3.05 0.62 0.00 -1.26 -5.08 105.19 103.10 2k70 n GLY 55 Ca -0.01 -0.78 -0.29 0.00 0.00 0.00 0.00 46.02 44.94 2k70 n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k70 s LYS 56 N -2.77 2.28 -0.20 1.61 1.02 0.11 -5.12 119.74 116.66 2k70 s LYS 56 Ca 0.00 -0.57 -0.29 0.00 0.02 0.00 0.00 55.97 55.13 2k70 s LYS 56 Cb 0.00 -1.99 0.00 0.00 -0.52 0.00 0.00 37.83 35.33 2k70 s LYS 56 CO 0.00 -0.12 1.04 -1.59 -0.92 0.00 0.00 175.35 173.76 2k70 s LYS 57 N 1.16 4.29 0.26 1.68 0.00 -1.26 -1.18 119.74 124.70 2k70 s LYS 57 Ca -0.02 1.38 0.11 0.00 0.00 0.00 0.00 55.97 57.43 2k70 s LYS 57 Cb -0.14 -3.62 -0.05 0.00 0.00 0.00 0.00 37.83 34.02 2k70 s LYS 57 CO -0.05 -0.56 -0.18 0.08 0.00 0.00 0.00 175.35 174.63 2k70 s VAL 58 N 2.95 2.29 0.22 1.79 1.01 0.52 -5.00 120.40 124.17 2k70 s VAL 58 Ca 0.45 -2.36 0.11 0.00 0.00 0.00 0.00 61.98 60.19 2k70 s VAL 58 Cb -0.16 -2.25 -0.05 0.00 0.00 0.00 0.00 36.38 33.93 2k70 s VAL 58 CO 0.09 -0.44 -0.21 -0.04 0.00 0.00 0.00 175.10 174.49 2k70 s MET 59 N -3.55 1.52 0.21 2.72 -1.94 -1.26 -1.04 119.30 115.96 2k70 s MET 59 Ca 0.28 -1.59 -0.05 0.00 -1.71 0.00 0.00 55.69 52.62 2k70 s MET 59 Cb -0.04 -1.69 0.02 0.00 2.01 0.00 0.00 34.83 35.13 2k70 s MET 59 CO 0.13 0.34 0.37 0.41 -0.01 0.00 0.00 175.02 176.27 2k70 n GLY 60 N -0.05 1.92 3.34 -0.03 0.00 -0.20 -4.92 105.19 105.24 2k70 n GLY 60 Ca -0.10 -1.31 -0.15 0.00 0.00 0.00 0.00 46.02 44.46 2k70 n GLY 60 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2k70 s MET 61 N -2.23 0.84 0.06 1.61 1.75 -1.26 -0.89 119.30 119.17 2k70 s MET 61 Ca 0.12 -0.10 -0.26 0.00 -1.25 0.00 0.00 55.69 54.20 2k70 s MET 61 Cb -0.02 0.38 0.08 0.00 2.84 0.00 0.00 34.83 38.12 2k70 s MET 61 CO 0.09 -0.25 0.73 -0.98 -0.65 0.00 0.00 175.02 173.96 2k70 s ARG 62 N -1.55 1.05 0.44 4.11 1.70 -1.01 -4.99 118.95 118.71 2k70 s ARG 62 Ca -0.11 -0.28 -0.23 0.00 -0.47 0.00 0.00 55.73 54.64 2k70 s ARG 62 Cb -0.03 0.49 -0.08 0.00 -0.57 0.00 0.00 34.95 34.76 2k70 s ARG 62 CO 0.04 -0.44 1.13 -1.25 -1.08 0.00 0.00 175.30 173.70 2k70 s PRO 63 N -3.04 3.89 0.27 3.89 0.04 -1.26 -0.74 135.00 138.05 2k70 s PRO 63 Ca 0.01 1.69 0.11 0.00 0.04 0.00 0.00 61.00 62.85 2k70 s PRO 63 Cb -0.01 -2.45 -0.05 0.00 0.04 0.00 0.00 34.50 32.03 2k70 s PRO 63 CO -0.08 -0.42 -0.17 0.14 0.04 0.00 0.00 177.00 176.52 2k70 s VAL 64 N -1.58 2.66 0.12 -0.36 -7.23 0.21 -4.81 120.40 109.40 2k70 s VAL 64 Ca 0.62 -2.28 0.05 0.00 -1.81 0.00 0.00 61.98 58.56 2k70 s VAL 64 Cb -0.26 -2.39 -0.22 0.00 0.56 0.00 0.00 36.38 34.07 2k70 s VAL 64 CO 0.32 -0.37 1.27 1.55 -0.31 0.00 0.00 175.10 177.56 2k70 h PRO 65 N 2.28 0.04 -1.08 4.82 0.13 -1.95 -3.43 132.00 132.80 2k70 h PRO 65 Ca -0.41 -0.07 0.36 0.00 -0.87 0.00 0.00 66.00 65.00 2k70 h PRO 65 Cb 1.25 0.03 -0.17 0.00 0.13 0.00 0.00 31.00 32.24 2k70 h PRO 65 CO 0.59 1.02 0.97 -0.59 -0.23 0.00 0.00 178.00 179.76 2k70 s PHE 66 N -2.73 -0.02 0.15 1.56 -0.12 -1.26 -4.73 117.98 110.82 2k70 s PHE 66 Ca 0.00 0.00 0.07 0.00 -0.05 0.00 0.00 56.93 56.95 2k70 s PHE 66 Cb 0.10 0.51 -0.04 0.00 -0.63 0.00 0.00 43.02 42.95 2k70 s PHE 66 CO 0.83 -0.04 -0.01 -0.51 -0.05 0.00 0.00 175.22 175.44 2k70 s LEU 67 N -2.54 3.34 0.03 -1.99 1.43 0.14 -4.98 118.68 114.11 2k70 s LEU 67 Ca 0.13 -0.33 0.04 0.00 -1.03 0.00 0.00 54.13 52.94 2k70 s LEU 67 Cb 0.03 -2.03 -0.04 0.00 0.03 0.00 0.00 46.19 44.19 2k70 s LEU 67 CO -0.05 0.12 -0.05 -0.70 0.23 0.00 0.00 176.35 175.90 2k70 s GLU 68 N -2.71 2.54 -0.03 1.70 2.56 -1.26 -0.37 118.70 121.13 2k70 s GLU 68 Ca 0.26 -0.75 -0.00 0.00 0.00 0.00 0.00 54.97 54.48 2k70 s GLU 68 Cb -0.10 -2.51 0.03 0.00 2.00 0.00 0.00 34.13 33.54 2k70 s GLU 68 CO 0.18 0.59 0.01 0.08 -0.56 0.00 0.00 175.26 175.56 2k70 s VAL 69 N -1.08 0.12 0.71 3.70 1.01 0.62 -4.97 120.40 120.51 2k70 s VAL 69 Ca 0.19 0.16 -0.11 0.00 0.00 0.00 0.00 61.98 62.22 2k70 s VAL 69 Cb -0.11 -0.26 0.02 0.00 0.00 0.00 0.00 36.38 36.03 2k70 s VAL 69 CO 0.10 0.16 1.07 -2.16 0.00 0.00 0.00 175.10 174.27 2k70 s PRO 70 N 1.31 2.74 0.43 2.72 0.04 -1.26 -1.27 135.00 139.70 2k70 s PRO 70 Ca -0.06 1.08 -0.25 0.00 0.04 0.00 0.00 61.00 61.80 2k70 s PRO 70 Cb -0.13 -1.96 -0.09 0.00 0.04 0.00 0.00 34.50 32.35 2k70 s PRO 70 CO -0.02 -1.26 1.31 -0.35 0.04 0.00 0.00 177.00 176.72 2k70 n PRO 71 N -3.11 2.02 -0.40 0.56 -0.04 -1.26 -2.66 135.00 130.11 2k70 n PRO 71 Ca 0.08 0.72 0.00 0.00 -0.04 0.00 0.00 63.50 64.26 2k70 n PRO 71 Cb 0.53 -2.44 0.00 0.00 -0.04 0.00 0.00 33.50 31.55 2k70 n PRO 71 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2k70 n LYS 72 N -0.00 0.00 -1.89 0.54 4.76 -0.52 -4.96 118.16 116.09 2k70 n LYS 72 Ca 0.06 0.00 -0.29 0.00 -2.87 0.00 0.00 58.31 55.21 2k70 n LYS 72 Cb 0.40 -3.84 0.15 0.00 -1.84 0.00 0.00 35.03 29.90 2k70 n LYS 72 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2k70 s GLY 73 N -2.00 1.70 -0.23 0.72 0.00 -1.09 -4.83 107.32 101.59 2k70 s GLY 73 Ca 0.00 -0.96 -0.11 0.00 0.00 0.00 0.00 44.72 43.65 2k70 s GLY 73 CO 0.00 -0.30 0.54 1.09 0.00 0.00 0.00 173.10 174.43 2k70 s ARG 74 N -5.74 0.51 -0.05 2.90 1.04 -1.26 -0.77 118.95 115.58 2k70 s ARG 74 Ca 0.69 1.08 -0.10 0.00 -1.04 0.00 0.00 55.73 56.36 2k70 s ARG 74 Cb -0.07 0.24 0.02 0.00 -2.04 0.00 0.00 34.95 33.10 2k70 s ARG 74 CO 0.51 -0.18 0.25 0.08 -0.04 0.00 0.00 175.30 175.92 2k70 s VAL 75 N 1.96 0.04 -0.06 4.99 1.01 0.37 -4.97 120.40 123.74 2k70 s VAL 75 Ca -0.08 -0.31 -0.02 0.00 0.00 0.00 0.00 61.98 61.58 2k70 s VAL 75 Cb -0.09 -0.46 -0.04 0.00 0.00 0.00 0.00 36.38 35.80 2k70 s VAL 75 CO -0.16 -0.17 0.04 -1.61 0.00 0.00 0.00 175.10 173.20 2k70 s GLU 76 N -0.66 3.05 -1.18 2.72 2.02 -1.26 -0.48 118.70 122.91 2k70 s GLU 76 Ca -0.08 -0.41 -0.23 0.00 0.02 0.00 0.00 54.97 54.28 2k70 s GLU 76 Cb -0.04 -2.86 -0.09 0.00 0.10 0.00 0.00 34.13 31.24 2k70 s GLU 76 CO 0.02 0.69 1.94 1.28 0.02 0.00 0.00 175.26 179.21 2k70 n LEU 77 N 1.77 3.07 -4.78 1.80 4.32 -0.10 -4.88 117.00 118.21 2k70 n LEU 77 Ca -0.17 -3.16 -0.36 0.00 -0.02 0.00 0.00 56.01 52.30 2k70 n LEU 77 Cb 0.53 -1.72 -0.03 0.00 -1.62 0.00 0.00 43.42 40.58 2k70 n LEU 77 CO 0.32 -1.82 0.75 -1.59 -1.22 0.00 0.00 177.39 173.82 2k70 s LYS 78 N 6.46 3.98 0.25 3.23 -2.85 -1.11 -3.48 119.74 126.22 2k70 s LYS 78 Ca 0.68 1.53 -0.31 0.00 -1.00 0.00 0.00 55.97 56.87 2k70 s LYS 78 Cb -0.00 -2.40 -0.12 0.00 -2.06 0.00 0.00 37.83 33.24 2k70 s LYS 78 CO 0.14 -0.30 1.57 -0.35 0.10 0.00 0.00 175.35 176.50 2k70 n PRO 79 N -0.39 2.47 0.00 1.78 -0.04 -1.26 -2.36 135.00 135.20 2k70 n PRO 79 Ca 0.07 0.88 0.00 0.00 -0.04 0.00 0.00 63.50 64.41 2k70 n PRO 79 Cb 0.50 -2.64 0.00 0.00 -0.04 0.00 0.00 33.50 31.32 2k70 n PRO 79 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k70 n GLY 80 N 2.66 1.25 0.00 0.55 0.00 -1.26 -4.87 105.19 103.52 2k70 n GLY 80 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2k70 n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k70 n GLY 81 N -2.00 0.02 3.02 -0.02 0.00 -1.04 -4.65 105.19 100.51 2k70 n GLY 81 Ca 0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 2k70 n GLY 81 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k70 s TYR 82 N -1.00 -0.16 -0.03 1.61 2.02 -1.00 -0.53 117.35 118.27 2k70 s TYR 82 Ca 0.00 0.40 -0.29 0.00 -0.37 0.00 0.00 57.07 56.81 2k70 s TYR 82 Cb 0.00 0.05 0.09 0.00 -0.40 0.00 0.00 41.96 41.69 2k70 s TYR 82 CO 0.00 -0.08 0.77 -3.38 -1.57 0.00 0.00 175.55 171.28 2k70 s HIS 83 N 0.15 -0.52 0.29 2.71 -3.43 -0.30 -2.76 115.29 111.44 2k70 s HIS 83 Ca -0.01 0.71 -0.28 0.00 -0.80 0.00 0.00 55.06 54.69 2k70 s HIS 83 Cb -0.02 0.47 -0.09 0.00 -1.43 0.00 0.00 32.58 31.51 2k70 s HIS 83 CO -0.00 -0.59 0.96 -0.06 -2.00 0.00 0.00 174.74 173.05 2k70 s PHE 84 N -2.00 3.78 -0.20 0.38 0.08 -0.64 -0.53 117.98 118.86 2k70 s PHE 84 Ca -0.04 1.83 -0.06 0.00 0.12 0.00 0.00 56.93 58.77 2k70 s PHE 84 Cb -0.00 -2.97 -0.03 0.00 -0.57 0.00 0.00 43.02 39.44 2k70 s PHE 84 CO 0.00 0.23 0.04 1.41 -0.10 0.00 0.00 175.22 176.80 2k70 s MET 85 N -1.70 3.81 -0.16 0.44 1.75 0.56 -0.64 119.30 123.37 2k70 s MET 85 Ca 0.47 -0.42 -0.05 0.00 -1.25 0.00 0.00 55.69 54.43 2k70 s MET 85 Cb -0.22 -3.18 -0.04 0.00 2.84 0.00 0.00 34.83 34.24 2k70 s MET 85 CO 0.28 0.13 0.03 -0.51 -0.65 0.00 0.00 175.02 174.30 2k70 s LEU 86 N 0.73 3.64 -0.08 4.11 1.02 -0.03 -1.25 118.68 126.81 2k70 s LEU 86 Ca 0.02 0.04 0.05 0.00 0.02 0.00 0.00 54.13 54.26 2k70 s LEU 86 Cb -0.14 -1.89 -0.00 0.00 0.02 0.00 0.00 46.19 44.18 2k70 s LEU 86 CO 0.02 0.21 -0.24 -0.76 0.02 0.00 0.00 176.35 175.61 2k70 s LEU 87 N 0.12 2.06 -0.46 1.79 2.01 -0.54 -0.84 118.68 122.83 2k70 s LEU 87 Ca 0.03 -0.53 -0.01 0.00 0.01 0.00 0.00 54.13 53.63 2k70 s LEU 87 Cb -0.13 -1.37 0.00 0.00 0.01 0.00 0.00 46.19 44.71 2k70 s LEU 87 CO 0.01 0.18 0.39 0.61 1.01 0.00 0.00 176.35 178.56 2k70 n GLY 88 N 3.33 0.22 3.54 -3.19 0.00 -0.02 -0.37 105.19 108.69 2k70 n GLY 88 Ca -0.19 -0.29 -0.38 0.00 0.00 0.00 0.00 46.02 45.17 2k70 n GLY 88 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2k70 n LEU 89 N -2.16 2.09 -0.85 0.99 -0.00 -1.00 -2.47 117.00 113.59 2k70 n LEU 89 Ca -0.08 0.79 0.09 0.00 -0.00 0.00 0.00 56.01 56.81 2k70 n LEU 89 Cb 0.55 -1.27 0.14 0.00 -0.00 0.00 0.00 43.42 42.84 2k70 n LEU 89 CO 0.23 -2.45 0.61 0.29 -0.00 0.00 0.00 177.39 176.06 2k70 n LYS 90 N -0.43 2.02 -3.80 1.47 4.76 -1.26 -4.83 118.16 116.09 2k70 n LYS 90 Ca 0.12 -1.90 -0.13 0.00 -2.87 0.00 0.00 58.31 53.54 2k70 n LYS 90 Cb 0.47 -1.38 -0.12 0.00 -1.84 0.00 0.00 35.03 32.15 2k70 n LYS 90 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2k70 s ARG 91 N -1.31 0.21 0.74 1.97 1.81 -1.26 -5.00 118.95 116.11 2k70 s ARG 91 Ca 0.28 0.27 -0.14 0.00 -1.72 0.00 0.00 55.73 54.42 2k70 s ARG 91 Cb 0.17 0.09 0.04 0.00 -0.45 0.00 0.00 34.95 34.80 2k70 s ARG 91 CO 0.24 -0.03 1.17 -1.25 -0.68 0.00 0.00 175.30 174.75 2k70 s PRO 92 N 0.17 2.15 -0.06 3.54 0.04 -1.26 -5.06 135.00 134.52 2k70 s PRO 92 Ca -0.01 1.63 -0.01 0.00 0.04 0.00 0.00 61.00 62.65 2k70 s PRO 92 Cb -0.02 -1.85 0.03 0.00 0.04 0.00 0.00 34.50 32.70 2k70 s PRO 92 CO -0.00 -1.80 0.02 -0.48 0.04 0.00 0.00 177.00 174.78 2k70 s LEU 93 N -5.30 0.50 -0.03 -3.56 0.05 -1.26 -5.05 118.68 104.03 2k70 s LEU 93 Ca 0.71 -0.02 0.08 0.00 0.05 0.00 0.00 54.13 54.95 2k70 s LEU 93 Cb -0.26 -0.31 0.27 0.00 -2.05 0.00 0.00 46.19 43.84 2k70 s LEU 93 CO 0.46 -0.20 1.14 2.29 -0.55 0.00 0.00 176.35 179.49 2k70 n LYS 94 N 5.08 1.93 -1.35 1.48 0.00 -1.26 -4.67 118.16 119.37 2k70 n LYS 94 Ca -0.08 -1.09 0.06 0.00 -0.00 0.00 0.00 58.31 57.21 2k70 n LYS 94 Cb 0.50 -1.40 -0.03 0.00 -0.00 0.00 0.00 35.03 34.09 2k70 n LYS 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2k70 n ALA 95 N 0.31 -2.43 -3.12 0.58 0.00 -1.26 -4.96 120.51 109.63 2k70 n ALA 95 Ca 0.10 0.60 -0.13 0.00 0.00 0.00 0.00 53.44 54.00 2k70 n ALA 95 Cb 0.36 -1.38 0.07 0.00 0.00 0.00 0.00 19.45 18.50 2k70 n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k70 n GLY 96 N -3.13 -0.27 2.91 0.00 0.00 -0.35 -5.01 105.19 99.34 2k70 n GLY 96 Ca -0.03 0.03 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 2k70 n GLY 96 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2k70 n GLU 97 N -3.43 0.97 -3.68 1.61 -0.58 -1.22 -4.95 120.64 109.36 2k70 n GLU 97 Ca -0.21 -2.86 -0.11 0.00 -0.42 0.00 0.00 57.16 53.56 2k70 n GLU 97 Cb 0.63 0.63 -0.09 0.00 -0.57 0.00 0.00 31.44 32.04 2k70 n GLU 97 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 2k70 s GLU 98 N -3.55 0.61 -0.00 3.49 -1.05 -1.26 -0.06 118.70 116.87 2k70 s GLU 98 Ca 0.08 0.88 -0.17 0.00 -0.15 0.00 0.00 54.97 55.61 2k70 s GLU 98 Cb -0.01 0.20 0.03 0.00 -0.44 0.00 0.00 34.13 33.92 2k70 s GLU 98 CO 0.05 -0.11 0.36 0.08 0.95 0.00 0.00 175.26 176.59 2k70 s VAL 99 N 0.84 0.05 0.45 1.83 1.01 -0.01 -4.97 120.40 119.59 2k70 s VAL 99 Ca -0.04 -0.44 -0.21 0.00 0.00 0.00 0.00 61.98 61.29 2k70 s VAL 99 Cb -0.05 -0.74 -0.10 0.00 0.00 0.00 0.00 36.38 35.49 2k70 s VAL 99 CO -0.07 -0.24 0.97 -1.83 0.00 0.00 0.00 175.10 173.93 2k70 s GLU 100 N -1.59 4.11 -0.00 2.72 -1.05 -1.26 -1.82 118.70 119.80 2k70 s GLU 100 Ca -0.11 1.19 0.06 0.00 -0.15 0.00 0.00 54.97 55.95 2k70 s GLU 100 Cb -0.04 -2.16 -0.02 0.00 -0.44 0.00 0.00 34.13 31.48 2k70 s GLU 100 CO 0.03 -0.14 -0.19 -0.51 0.95 0.00 0.00 175.26 175.40 2k70 s LEU 101 N -3.27 2.06 0.05 1.83 1.02 -0.23 -4.29 118.68 115.86 2k70 s LEU 101 Ca 0.63 -0.37 -0.03 0.00 0.02 0.00 0.00 54.13 54.39 2k70 s LEU 101 Cb -0.11 -0.95 -0.04 0.00 0.02 0.00 0.00 46.19 45.11 2k70 s LEU 101 CO 0.15 0.21 0.25 -1.81 0.02 0.00 0.00 176.35 175.17 2k70 s ASP 102 N -0.58 6.41 -0.07 2.29 1.01 -0.07 -0.34 116.67 125.32 2k70 s ASP 102 Ca 0.07 0.40 0.05 0.00 0.71 0.00 0.00 52.55 53.78 2k70 s ASP 102 Cb -0.07 -2.02 -0.01 0.00 1.01 0.00 0.00 42.92 41.83 2k70 s ASP 102 CO -0.00 0.18 -0.23 -0.76 0.21 0.00 0.00 175.17 174.56 2k70 s LEU 103 N -2.30 2.04 -0.21 1.23 1.02 0.28 -0.93 118.68 119.82 2k70 s LEU 103 Ca 0.33 -0.50 -0.04 0.00 0.02 0.00 0.00 54.13 53.94 2k70 s LEU 103 Cb -0.13 -1.32 -0.02 0.00 0.02 0.00 0.00 46.19 44.75 2k70 s LEU 103 CO 0.23 0.20 -0.02 -0.76 0.02 0.00 0.00 176.35 176.02 2k70 s LEU 104 N 0.03 3.06 0.14 1.79 1.43 -0.25 -1.88 118.68 123.01 2k70 s LEU 104 Ca -0.08 -0.30 0.11 0.00 -1.03 0.00 0.00 54.13 52.83 2k70 s LEU 104 Cb -0.15 -1.78 -0.04 0.00 0.03 0.00 0.00 46.19 44.25 2k70 s LEU 104 CO 0.05 0.03 -0.26 -0.36 0.23 0.00 0.00 176.35 176.03 2k70 s PHE 105 N 1.21 2.31 0.28 0.29 0.40 -0.53 -0.61 117.98 121.33 2k70 s PHE 105 Ca 0.03 -0.38 -0.30 0.00 -0.60 0.00 0.00 56.93 55.68 2k70 s PHE 105 Cb -0.14 -1.23 -0.12 0.00 0.51 0.00 0.00 43.02 42.03 2k70 s PHE 105 CO -0.00 0.37 1.48 0.00 0.70 0.00 0.00 175.22 177.77 2k70 n ALA 106 N 0.80 1.84 -1.49 5.36 0.00 -0.10 -3.36 120.51 123.56 2k70 n ALA 106 Ca -0.17 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.65 2k70 n ALA 106 Cb 0.53 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.62 2k70 n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k70 n GLY 107 N 1.90 0.85 2.02 0.00 0.00 -1.26 -4.48 105.19 104.22 2k70 n GLY 107 Ca 0.09 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.49 2k70 n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k70 n GLY 108 N -0.90 0.58 3.79 -0.02 0.00 -1.21 -5.03 105.19 102.39 2k70 n GLY 108 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 2k70 n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k70 s LYS 109 N -0.05 4.31 0.03 1.61 3.01 -1.23 -5.00 119.74 122.43 2k70 s LYS 109 Ca 0.00 0.82 0.04 0.00 -1.01 0.00 0.00 55.97 55.82 2k70 s LYS 109 Cb 0.00 -3.28 -0.02 0.00 -1.01 0.00 0.00 37.83 33.52 2k70 s LYS 109 CO 0.00 0.53 -0.12 0.54 0.51 0.00 0.00 175.35 176.81 2k70 s VAL 110 N -0.78 0.91 -0.12 3.17 0.11 -1.26 -1.46 120.40 120.97 2k70 s VAL 110 Ca 0.31 -0.91 -0.05 0.00 -2.93 0.00 0.00 61.98 58.41 2k70 s VAL 110 Cb -0.20 -0.84 0.06 0.00 -1.53 0.00 0.00 36.38 33.87 2k70 s VAL 110 CO 0.20 -0.05 0.24 -0.22 -3.33 0.00 0.00 175.10 171.93 2k70 s LEU 111 N -1.08 -0.14 -0.04 2.54 0.20 -0.79 -4.98 118.68 114.39 2k70 s LEU 111 Ca -0.01 0.53 -0.18 0.00 0.69 0.00 0.00 54.13 55.16 2k70 s LEU 111 Cb -0.07 0.62 -0.05 0.00 -0.43 0.00 0.00 46.19 46.25 2k70 s LEU 111 CO 0.01 -0.23 0.51 -0.75 -0.29 0.00 0.00 176.35 175.60 2k70 s LYS 112 N 2.21 4.23 0.29 1.98 2.47 -1.26 -0.55 119.74 129.10 2k70 s LYS 112 Ca -0.00 0.56 0.12 0.00 -1.56 0.00 0.00 55.97 55.08 2k70 s LYS 112 Cb -0.12 -3.34 -0.05 0.00 -1.46 0.00 0.00 37.83 32.86 2k70 s LYS 112 CO -0.08 0.39 -0.18 0.14 0.16 0.00 0.00 175.35 175.77 2k70 s VAL 113 N -0.16 2.42 -0.10 4.02 -7.23 0.54 -5.00 120.40 114.88 2k70 s VAL 113 Ca 0.27 -2.38 0.02 0.00 -1.81 0.00 0.00 61.98 58.08 2k70 s VAL 113 Cb -0.17 -2.34 -0.01 0.00 0.56 0.00 0.00 36.38 34.42 2k70 s VAL 113 CO 0.14 -0.38 -0.16 -0.69 -0.31 0.00 0.00 175.10 173.70 2k70 s VAL 114 N -2.54 2.83 0.02 1.32 1.01 -1.26 -1.06 120.40 120.71 2k70 s VAL 114 Ca 0.30 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.54 2k70 s VAL 114 Cb -0.04 -2.15 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 2k70 s VAL 114 CO 0.15 0.55 -0.07 -0.76 0.00 0.00 0.00 175.10 174.97 2k70 s LEU 115 N 0.08 2.11 1.01 3.92 1.43 -0.76 -4.90 118.68 121.58 2k70 s LEU 115 Ca -0.07 -0.29 -0.15 0.00 -1.03 0.00 0.00 54.13 52.59 2k70 s LEU 115 Cb -0.15 -0.24 0.20 0.00 0.03 0.00 0.00 46.19 46.03 2k70 s LEU 115 CO 0.05 -0.04 1.18 -2.16 0.23 0.00 0.00 176.35 175.60 2k70 s PRO 116 N -0.73 0.29 -0.09 1.29 0.04 -1.26 -0.83 135.00 133.71 2k70 s PRO 116 Ca -0.03 0.00 0.03 0.00 0.04 0.00 0.00 61.00 61.05 2k70 s PRO 116 Cb -0.05 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.72 2k70 s PRO 116 CO 0.00 -2.71 -0.21 0.08 0.04 0.00 0.00 177.00 174.20 2k70 s VAL 117 N -3.36 1.80 0.38 -0.36 1.01 0.91 -1.05 120.40 119.74 2k70 s VAL 117 Ca 0.69 -0.87 0.08 0.00 0.00 0.00 0.00 61.98 61.88 2k70 s VAL 117 Cb -0.10 -1.58 -0.06 0.00 0.00 0.00 0.00 36.38 34.63 2k70 s VAL 117 CO 0.54 0.50 0.03 -1.61 0.00 0.00 0.00 175.10 174.56 2k70 s GLU 118 N 0.47 2.02 0.58 2.72 0.41 0.60 -1.21 118.70 124.30 2k70 s GLU 118 Ca -0.17 -1.92 -0.01 0.00 -0.41 0.00 0.00 54.97 52.46 2k70 s GLU 118 Cb -0.17 -1.80 0.12 0.00 -1.78 0.00 0.00 34.13 30.49 2k70 s GLU 118 CO 0.07 0.02 0.80 0.00 -0.49 0.00 0.00 175.26 175.66 2k70 n ALA 119 N -0.99 0.10 -1.92 5.21 0.00 -1.26 -1.91 120.51 119.74 2k70 n ALA 119 Ca -0.04 -1.54 0.00 0.00 0.00 0.00 0.00 53.44 51.86 2k70 n ALA 119 Cb 0.65 0.24 0.00 0.00 0.00 0.00 0.00 19.45 20.34 2k70 n ALA 119 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39